0 B9R1.69 Cc1c(cc(cn1)Br)Br LS20041 [0,0,0,0,0,0|2,1,1]=4 1 B9R1.69 Cc1c(ccc(n1)Cl)Br LS20733 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.69 Cc1c(ccc(n1)Cl)F LS20355 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.69 Cc1c(ccc(n1)Cl)N LS20510 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.69 Cc1cc(c(=O)[nH]c1)N LS20003 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.69 Cc1cc(c(nc1)Br)Br LS20386 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.69 Cc1cc(c(nc1)Br)C LS20029 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.69 Cc1cc(c(nc1)Br)N LS20369 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.69 Cc1cc(c(nc1)C)C LS20056 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.69 Cc1cc(c(nc1)Cl)F LS20093 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.69 Cc1cc(c(nc1)Cl)N LS20551 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.69 Cc1cc(c(nc1)F)I LS20636 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.69 Cc1cc(c(nc1)N)Br LS20448 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.69 Cc1cc(ccc1Br)F LS10433 [0,0,0,0,0,0|3,1,0]=4 14 B9R1.69 Cc1cc(ccc1Br)O LS10569 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.69 Cc1cc(ccc1Cl)I LS10339 [0,0,0,0,0,0|3,1,0]=4 16 B9R1.69 Cc1cc(ccc1F)N LS10454 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.69 Cc1cc(ccc1O)Br LS10229 [0,0,0,0,0,0|2,1,1]=4 18 B9R1.69 Cc1cc(ccc1O)Cl LS10662 [0,0,0,0,0,0|2,0,1]=3 19 B9R1.69 Cc1cc(cnc1Br)Br LS20558 [0,0,0,0,0,0|2,1,1]=4 20 B9R1.69 Cc1cc(cnc1Br)Cl LS20774 [0,0,0,0,0,0|2,0,1]=3 21 B9R1.69 Cc1cc(cnc1Br)F LS20363 [0,0,0,0,0,0|2,1,1]=4 22 B9R1.69 Cc1cc(cnc1Cl)F LS20354 [0,0,0,0,0,0|2,1,1]=4 23 B9R1.69 Cc1cc(cnc1F)N LS20741 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.69 Cc1cc(cnc1F)O LS20344 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.69 Cc1cc(cnc1N)Br LS20513 [0,0,0,0,0,0|2,1,1]=4 26 B9R1.69 Cc1cc(cnc1O)Br LS20335 [0,0,0,0,0,0|1,1,2]=4 27 B9R1.69 Cc1ccc(c(c1)Br)F LS10435 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.69 Cc1ccc(c(c1)Br)O LS11738 [0,0,0,0,0,0|3,0,1]=4 29 B9R1.69 Cc1ccc(c(c1)Cl)C LS11676 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.69 Cc1ccc(c(c1)F)Br LS10432 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.69 Cc1ccc(c(c1)F)F LS10430 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.69 Cc1ccc(c(c1)N)Br LS10019 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.69 Cc1ccc(c(c1)N)I LS10064 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.69 Cc1ccc(c(c1)O)Br LS11750 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.69 Cc1ccc(cc1Br)Br LS10325 [0,0,0,0,0,0|3,1,0]=4 36 B9R1.69 Cc1ccc(cc1Br)F LS10434 [0,0,0,0,0,0|3,1,0]=4 37 B9R1.69 Cc1ccc(cc1Cl)F LS10431 [0,0,0,0,0,0|3,1,0]=4 38 B9R1.69 Cc1ccc(cc1F)N LS10457 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.69 Cc1ccc(cc1N)Br LS10331 [0,0,0,0,0,0|3,1,0]=4 40 B9R1.69 Cc1ccc(cc1N)F LS10455 [0,0,0,0,0,0|3,1,0]=4 41 B9R1.69 Cc1ccc(nc1Cl)Cl LS20613 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.69 Cc1cnc(cc1Cl)Cl LS21148 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.69 c1c(c(cnc1Cl)F)I LS20356 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.69 c1c(c(nc(n1)Cl)O)F LS20170 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.69 c1c(c(nnc1Cl)N)Br LS20520 [0,0,0,0,0,0|3,0,1]=4 46 B9R1.69 c1c(cnc(c1Br)Cl)Br LS20362 [0,0,0,0,0,0|2,1,1]=4 47 B9R1.69 c1c(cnc(c1Br)Cl)N LS20556 [0,0,0,0,0,0|3,0,1]=4 48 B9R1.69 c1c(cnc(c1Br)F)Br LS20214 [0,0,0,0,0,0|2,1,1]=4 49 B9R1.69 c1c(cnc(c1Br)F)N LS20350 [0,0,0,0,0,0|3,0,1]=4 50 B9R1.69 c1c(cnc(c1Br)O)F LS20211 [0,0,0,0,0,0|1,1,2]=4 51 B9R1.69 c1c(cnc(c1Cl)Cl)Br LS20479 [0,0,0,0,0,0|2,1,1]=4 52 B9R1.69 c1c(cnc(c1Cl)Cl)N LS20508 [0,0,0,0,0,0|3,0,1]=4 53 B9R1.69 c1c(cnc(c1F)Br)F LS20400 [0,0,0,0,0,0|2,1,1]=4 54 B9R1.69 c1c(cnc(c1F)Cl)Br LS20548 [0,0,0,0,0,0|2,1,1]=4 55 B9R1.69 c1c(cnc(c1F)N)Cl LS20235 [0,0,0,0,0,0|2,0,1]=3 56 B9R1.69 c1c(cnc(c1I)N)Br LS20269 [0,0,0,0,0,0|2,1,1]=4 57 B9R1.69 c1c(cnc(c1N)Br)F LS20555 [0,0,0,0,0,0|2,1,1]=4 58 B9R1.69 c1c(cnc(c1N)Cl)Br LS20557 [0,0,0,0,0,0|2,1,1]=4 59 B9R1.69 c1c(cnc(c1N)Cl)Cl LS20380 [0,0,0,0,0,0|2,0,1]=3 60 B9R1.69 c1c(cnc(c1N)F)Br LS20554 [0,0,0,0,0,0|2,1,1]=4 61 B9R1.69 c1c(cnc(c1N)N)Br LS20387 [0,0,0,0,0,0|2,1,1]=4 62 B9R1.69 c1c(cnc(c1N)O)Br LS20340 [0,0,0,0,0,0|1,1,2]=4 63 B9R1.69 c1cc(c(cc1Br)Br)F LS10353 [0,0,0,0,0,0|3,1,0]=4 64 B9R1.69 c1cc(c(cc1Br)Br)N LS11452 [0,0,0,0,0,0|3,1,0]=4 65 B9R1.69 c1cc(c(cc1Br)Br)O LS11451 [0,0,0,0,0,0|2,1,1]=4 66 B9R1.69 c1cc(c(cc1Br)Cl)Cl LS10687 [0,0,0,0,0,0|3,1,0]=4 67 B9R1.69 c1cc(c(cc1Br)Cl)N LS11838 [0,0,0,0,0,0|3,1,0]=4 68 B9R1.69 c1cc(c(cc1Br)F)Br LS11494 [0,0,0,0,0,0|3,1,0]=4 69 B9R1.69 c1cc(c(cc1Br)F)N LS11405 [0,0,0,0,0,0|3,1,0]=4 70 B9R1.69 c1cc(c(cc1Br)I)F LS11632 [0,0,0,0,0,0|3,1,0]=4 71 B9R1.69 c1cc(c(cc1Br)I)N LS10333 [0,0,0,0,0,0|3,1,0]=4 72 B9R1.69 c1cc(c(cc1Br)N)Br LS11325 [0,0,0,0,0,0|3,1,0]=4 73 B9R1.69 c1cc(c(cc1Br)N)Cl LS10371 [0,0,0,0,0,0|3,1,0]=4 74 B9R1.69 c1cc(c(cc1Br)N)N LS00002 [0,0,0,0,0,0|3,1,0]=4 75 B9R1.69 c1cc(c(cc1Br)N)O LS10615 [0,0,0,0,0,0|2,1,1]=4 76 B9R1.69 c1cc(c(cc1Br)O)Cl LS10495 [0,0,0,0,0,0|2,1,0]=3 77 B9R1.69 c1cc(c(cc1Br)O)F LS10459 [0,0,0,0,0,0|2,1,0]=3 78 B9R1.69 c1cc(c(cc1Br)O)N LS10644 [0,0,0,0,0,0|2,1,0]=3 79 B9R1.69 c1cc(c(cc1Cl)Br)O LS11737 [0,0,0,0,0,0|2,0,1]=3 80 B9R1.69 c1cc(c(cc1Cl)Cl)Br LS11198 [0,0,0,0,0,0|3,0,0]=3 81 B9R1.69 c1cc(c(cc1Cl)Cl)F LS11569 [0,0,0,0,0,0|3,0,0]=3 82 B9R1.69 c1cc(c(cc1Cl)I)N LS10340 [0,0,0,0,0,0|3,0,0]=3 83 B9R1.69 c1cc(c(cc1Cl)N)Br LS10347 [0,0,0,0,0,0|3,0,0]=3 84 B9R1.69 c1cc(c(cc1Cl)N)O LS10668 [0,0,0,0,0,0|2,0,1]=3 85 B9R1.69 c1cc(c(cc1Cl)O)I LS10194 [0,0,0,0,0,0|2,0,0]=2 86 B9R1.69 c1cc(c(cc1F)Br)N LS11175 [0,0,0,0,0,0|3,1,0]=4 87 B9R1.69 c1cc(c(cc1F)Br)O LS10461 [0,0,0,0,0,0|2,1,1]=4 88 B9R1.69 c1cc(c(cc1F)Cl)S LS10397 [0,0,0,0,0,0|2,2,0]=4 89 B9R1.69 c1cc(c(cc1F)N)Br LS10452 [0,0,0,0,0,0|3,1,0]=4 90 B9R1.69 c1cc(c(cc1F)N)O LS10399 [0,0,0,0,0,0|2,1,1]=4 91 B9R1.69 c1cc(c(cc1F)O)Br LS10489 [0,0,0,0,0,0|2,1,0]=3 92 B9R1.69 c1cc(c(cc1F)O)Cl LS10485 [0,0,0,0,0,0|2,1,0]=3 93 B9R1.69 c1cc(c(cc1I)Cl)Br LS10093 [0,0,0,0,0,0|3,1,0]=4 94 B9R1.69 c1cc(c(cc1I)F)N LS10451 [0,0,0,0,0,0|3,1,0]=4 95 B9R1.69 c1cc(c(cc1N)Br)Cl LS10236 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.69 c1cc(c(cc1N)Br)F LS10387 [0,0,0,0,0,0|4,0,0]=4 97 B9R1.69 c1cc(c(cc1N)Cl)Cl LS11577 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.69 c1cc(c(cc1N)Cl)F LS11518 [0,0,0,0,0,0|4,0,0]=4 99 B9R1.69 c1cc(c(cc1N)F)I LS10449 [0,0,0,0,0,0|4,0,0]=4 100 B9R1.69 c1cc(c(cc1N)O)Cl LS10724 [0,0,0,0,0,0|3,0,0]=3 101 B9R1.69 c1cc(c(cc1O)Br)Cl LS10344 [0,0,0,0,0,0|4,0,0]=4 102 B9R1.69 c1cc(c(cc1O)Br)F LS10460 [0,0,0,0,0,0|4,0,0]=4 103 B9R1.69 c1cc(c(cc1O)Br)O LS11757 [0,0,0,0,0,0|3,0,1]=4 104 B9R1.69 c1cc(c(cc1O)Cl)Br LS10343 [0,0,0,0,0,0|4,0,0]=4 105 B9R1.69 c1cc(c(cc1O)Cl)N LS11520 [0,0,0,0,0,0|4,0,0]=4 106 B9R1.69 c1cc(c(cc1O)F)N LS00146 [0,0,0,0,0,0|4,0,0]=4 107 B9R1.69 c1cc(c(cc1O)F)O LS00052 [0,0,0,0,0,0|3,0,1]=4 108 B9R1.69 c1cc(c(cc1O)N)F LS10007 [0,0,0,0,0,0|4,0,0]=4 109 B9R1.69 c1cc(c(cc1O)O)Br LS10165 [0,0,0,0,0,0|3,0,0]=3 110 B9R1.69 c1cc(c(cc1S)Cl)F LS10394 [0,0,0,0,0,0|4,0,0]=4 111 B9R1.69 c1cc(nc(c1N)Cl)Cl LS20713 [0,0,0,0,0,0|4,0,0]=4 112 B9R1.69 c1cc(nc(c1N)N)Cl LS20019 [0,0,0,0,0,0|4,0,0]=4 113 B8R1.3 C1=CC(=O)C=CC1=O LS41078 [1,0,0,0,0,0|2,0,0]=3 114 B8R1.3 Cc1ccc(cc1)Cl LS11416 [1,0,0,0,0,0|2,0,0]=3 115 B8R1.3 Cc1ccc(cn1)Br LS20399 [1,0,0,0,0,0|1,1,1]=4 116 B8R1.3 Cc1ccc(nc1)Br LS20538 [1,0,0,0,0,0|2,0,1]=4 117 B8R1.3 Cc1ccc(nc1)Cl LS20543 [1,0,0,0,0,0|2,0,1]=4 118 B8R1.3 Cc1ccc(nn1)Cl LS21118 [1,0,0,0,0,0|2,0,1]=4 119 B8R1.3 c1c(cnc(n1)N)Cl LS21227 [1,0,0,0,0,0|2,0,1]=4 120 B8R1.3 c1cc(=O)[nH]cc1Br LS21018 [1,0,0,0,0,0|0,1,0]=2 121 B8R1.3 c1cc(ccc1Br)I LS11203 [1,0,0,0,0,0|2,1,0]=4 122 B8R1.3 c1cc(ccc1F)F LS11211 [1,0,0,0,0,0|2,1,0]=4 123 B8R1.3 c1cc(ccc1N)Br LS11446 [1,0,0,0,0,0|2,1,0]=4 124 B8R1.3 c1cc(ccc1N)I LS11481 [1,0,0,0,0,0|2,1,0]=4 125 B8R1.3 c1cc(ccc1O)Br LS11445 [1,0,0,0,0,0|1,1,1]=4 126 B8R1.3 c1cc(ccc1O)F LS10647 [1,0,0,0,0,0|1,1,1]=4 127 B8R1.3 c1cc(ccc1O)I LS10366 [1,0,0,0,0,0|1,1,1]=4 128 B8R1.3 c1cc(ncc1Br)Br LS21029 [1,0,0,0,0,0|1,1,1]=4 129 B8R1.3 c1cc(ncc1Br)Cl LS20547 [1,0,0,0,0,0|1,1,1]=4 130 B8R1.3 c1cc(ncc1Br)F LS20408 [1,0,0,0,0,0|1,1,1]=4 131 B8R1.3 c1cc(ncc1Br)I LS20184 [1,0,0,0,0,0|1,1,1]=4 132 B8R1.3 c1cc(ncc1Cl)Br LS20546 [1,0,0,0,0,0|1,0,1]=3 133 B8R1.3 c1cc(ncc1Cl)Cl LS20534 [1,0,0,0,0,0|1,0,1]=3 134 B8R1.3 c1cc(ncc1Cl)F LS20537 [1,0,0,0,0,0|1,0,1]=3 135 B8R1.3 c1cc(ncc1F)Br LS20585 [1,0,0,0,0,0|1,1,1]=4 136 B8R1.3 c1cc(ncc1F)F LS20951 [1,0,0,0,0,0|1,1,1]=4 137 B8R1.3 c1cc(ncc1F)N LS20484 [1,0,0,0,0,0|1,1,1]=4 138 B8R1.3 c1cc(ncc1F)O LS20722 [1,0,0,0,0,0|0,1,2]=4 139 B8R1.3 c1cc(ncc1I)Cl LS20455 [1,0,0,0,0,0|1,1,1]=4 140 B8R1.3 c1cc(ncc1I)F LS20342 [1,0,0,0,0,0|1,1,1]=4 141 B8R1.3 c1cc(ncc1I)N LS20442 [1,0,0,0,0,0|1,1,1]=4 142 B8R1.3 c1cc(ncc1N)Cl LS20443 [1,0,0,0,0,0|2,0,1]=4 143 B8R1.3 c1cc(ncc1N)F LS20550 [1,0,0,0,0,0|2,0,1]=4 144 B8R1.3 c1cc(ncc1N)O LS20334 [1,0,0,0,0,0|1,0,2]=4 145 B8R1.3 c1cc(ncc1O)F LS20343 [1,0,0,0,0,0|2,0,1]=4 146 B8R1.3 c1cc(ncc1O)N LS20718 [1,0,0,0,0,0|2,0,1]=4 147 B8R1.3 c1cc(nnc1N)Cl LS20255 [1,0,0,0,0,0|2,0,1]=4 148 B8R1.4 Cc1cc(cnc1)Br LS20401 [1,0,0,0,0,0|1,1,1]=4 149 B8R1.4 Cc1cc(cnc1)C LS41253 [1,0,0,0,0,0|2,0,1]=4 150 B8R1.4 Cc1cccc(n1)Cl LS20527 [1,0,0,0,0,0|3,0,0]=4 151 B8R1.4 Cc1ccnc(c1)Cl LS20535 [1,0,0,0,0,0|3,0,0]=4 152 B8R1.4 c1c(cncc1Br)Br LS20981 [1,0,0,0,0,0|1,1,1]=4 153 B8R1.4 c1c(cncc1Br)N LS20949 [1,0,0,0,0,0|1,1,1]=4 154 B8R1.4 c1c(cncc1Cl)Cl LS20213 [1,0,0,0,0,0|1,0,1]=3 155 B8R1.4 c1c(cncc1F)O LS20013 [1,0,0,0,0,0|0,1,1]=3 156 B8R1.4 c1c(cnnc1Cl)Cl LS21226 [1,0,0,0,0,0|2,0,1]=4 157 B8R1.4 c1cc(cc(c1)Br)N LS10546 [1,0,0,0,0,0|2,1,0]=4 158 B8R1.4 c1cc(cc(c1)F)F LS10472 [1,0,0,0,0,0|2,1,0]=4 159 B8R1.4 c1cc(cc(c1)F)O LS11397 [1,0,0,0,0,0|1,1,0]=3 160 B8R1.4 c1cc(cc(c1)I)Br LS11202 [1,0,0,0,0,0|2,1,0]=4 161 B8R1.4 c1cc(cc(c1)I)N LS10554 [1,0,0,0,0,0|2,1,0]=4 162 B8R1.4 c1cc(cc(c1)S)O LS11830 [1,0,0,0,0,0|2,0,0]=3 163 B8R1.4 c1cc(nc(c1)Br)Cl LS20266 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.4 c1cc(nc(c1)Cl)N LS20252 [1,0,0,0,0,0|3,0,0]=4 165 B8R1.4 c1cc(nc(c1)Cl)O LS20221 [1,0,0,0,0,0|2,0,0]=3 166 B8R1.4 c1cnc(cc1Br)Cl LS20559 [1,0,0,0,0,0|3,0,0]=4 167 B8R1.4 c1cnc(cc1Br)O LS20336 [1,0,0,0,0,0|2,1,0]=4 168 B8R1.4 c1cnc(cc1Cl)Cl LS21157 [1,0,0,0,0,0|3,0,0]=4 169 B8R1.4 c1cnc(cc1Cl)N LS20373 [1,0,0,0,0,0|3,0,0]=4 170 B8R1.4 c1cnc(cc1F)Cl LS20357 [1,0,0,0,0,0|3,0,0]=4 171 B8R1.4 c1cnc(cc1I)Cl LS20424 [1,0,0,0,0,0|3,0,0]=4 172 B8R1.4 c1cnc(cc1N)Cl LS20509 [1,0,0,0,0,0|3,0,0]=4 173 B8R1.4 c1cnc(cc1O)Cl LS20425 [1,0,0,0,0,0|2,0,0]=3 174 B8R1.4 c1cnc(cc1O)N LS20319 [1,0,0,0,0,0|3,0,0]=4 175 B8R1.5 Cc1c(cccn1)Br LS20529 [1,0,0,0,0,0|2,0,1]=4 176 B8R1.5 Cc1c(cccn1)F LS00100 [1,0,0,0,0,0|2,0,1]=4 177 B8R1.5 Cc1c(cccn1)O LS20321 [1,0,0,0,0,0|1,0,1]=3 178 B8R1.5 Cc1ccccc1Cl LS11417 [1,0,0,0,0,0|3,0,0]=4 179 B8R1.5 Cc1cccnc1Br LS20246 [1,0,0,0,0,0|2,0,1]=4 180 B8R1.5 Cc1cccnc1F LS20403 [1,0,0,0,0,0|2,0,1]=4 181 B8R1.5 Cc1cccnc1N LS20579 [1,0,0,0,0,0|2,0,1]=4 182 B8R1.5 Cc1cccnc1O LS20286 [1,0,0,0,0,0|1,0,2]=4 183 B8R1.5 Cn1ccccc1=O LS40391 [1,0,0,0,0,0|3,0,0]=4 184 B8R1.5 c1cc(c(nc1)Br)Br LS20191 [1,0,0,0,0,0|2,0,1]=4 185 B8R1.5 c1cc(c(nc1)Br)F LS20948 [1,0,0,0,0,0|2,0,1]=4 186 B8R1.5 c1cc(c(nc1)Br)N LS20186 [1,0,0,0,0,0|2,0,1]=4 187 B8R1.5 c1cc(c(nc1)Cl)Cl LS20542 [1,0,0,0,0,0|2,0,1]=4 188 B8R1.5 c1cc(c(nc1)Cl)F LS20427 [1,0,0,0,0,0|2,0,1]=4 189 B8R1.5 c1cc(c(nc1)Cl)I LS20536 [1,0,0,0,0,0|2,0,1]=4 190 B8R1.5 c1cc(c(nc1)F)Br LS20414 [1,0,0,0,0,0|2,0,1]=4 191 B8R1.5 c1cc(c(nc1)F)F LS20846 [1,0,0,0,0,0|2,0,1]=4 192 B8R1.5 c1cc(c(nc1)I)N LS20187 [1,0,0,0,0,0|2,0,1]=4 193 B8R1.5 c1cc(c(nc1)N)Br LS20925 [1,0,0,0,0,0|2,0,1]=4 194 B8R1.5 c1cc(c(nc1)N)F LS20418 [1,0,0,0,0,0|2,0,1]=4 195 B8R1.5 c1cc(c(nc1)N)N LS20494 [1,0,0,0,0,0|2,0,1]=4 196 B8R1.5 c1ccc(c(c1)Br)Br LS11475 [1,0,0,0,0,0|3,0,0]=4 197 B8R1.5 c1ccc(c(c1)Br)I LS10473 [1,0,0,0,0,0|3,0,0]=4 198 B8R1.5 c1ccc(c(c1)Cl)I LS10577 [1,0,0,0,0,0|3,0,0]=4 199 B8R1.5 c1ccc(c(c1)N)Br LS11448 [1,0,0,0,0,0|3,0,0]=4 200 B8R1.5 c1ccc(c(c1)N)Cl LS11568 [1,0,0,0,0,0|3,0,0]=4 201 B8R1.5 c1ccc(c(c1)N)I LS10537 [1,0,0,0,0,0|3,0,0]=4 202 B8R1.5 c1ccc(c(c1)O)Br LS11447 [1,0,0,0,0,0|2,0,0]=3 203 B8R1.5 c1ccc(c(c1)O)F LS10471 [1,0,0,0,0,0|2,0,0]=3 204 B8R1.5 c1ccc(c(c1)O)I LS00004 [1,0,0,0,0,0|2,0,0]=3 205 B8R1.5 c1ccn(c(=O)c1)O LS21131 [1,0,0,0,0,0|2,0,0]=3 206 B10R1.22 Cc1cc(cc(c1N)Br)Cl LS10240 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.22 c1c(cc(c(c1Br)O)Br)Cl LS11339 [0,1,0,0,0,0|2,0,1]=4 208 B10R1.22 c1c(cc(c(c1Cl)N)Br)Cl LS10342 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.22 c1c(cc(c(c1Cl)O)Cl)Cl LS11505 [0,1,0,0,0,0|2,0,1]=4 210 B10R1.22 c1c(cc(c(c1F)N)F)Cl LS10383 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.22 c1c(cc(c(c1O)O)F)Cl LS10081 [0,1,0,0,0,0|1,0,1]=3 212 B10R1.25 COc1c(cc(cn1)Cl)Br LS20332 [0,1,0,0,0,0|1,0,2]=4 213 B10R1.25 Cc1cc(ccc1C=O)F LS10500 [0,1,0,0,0,0|2,1,0]=4 214 B10R1.25 Cc1cc(ccc1C=O)O LS11394 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.25 c1c(cnc(c1Br)C#N)Cl LS20200 [0,1,0,0,0,0|2,0,1]=4 216 B10R1.25 c1cc(c(cc1Br)F)C=O LS10657 [0,1,0,0,0,0|2,1,0]=4 217 B10R1.25 c1cc(c(cc1Br)O)C=O LS10088 [0,1,0,0,0,0|1,1,0]=3 218 B10R1.25 c1cc(c(cc1Cl)Br)C=O LS10197 [0,1,0,0,0,0|2,0,0]=3 219 B10R1.25 c1cc(c(cc1Cl)Cl)CN LS11223 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.25 c1cc(c(cc1Cl)F)C=O LS10509 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.25 c1cc(c(cc1Cl)N)C#N LS11442 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.25 c1cc(c(cc1Cl)O)C=O LS11382 [0,1,0,0,0,0|1,0,0]=2 223 B10R1.25 c1cc(c(cc1F)Br)C=O LS10393 [0,1,0,0,0,0|2,1,0]=4 224 B10R1.25 c1cc(c(cc1F)Cl)C=O LS11829 [0,1,0,0,0,0|2,1,0]=4 225 B10R1.25 c1cc(c(cc1F)O)C=O LS10219 [0,1,0,0,0,0|1,1,0]=3 226 B10R1.25 c1cc(c(cc1O)Cl)C=O LS11740 [0,1,0,0,0,0|3,0,0]=4 227 B10R1.30 COc1cc(ccc1Br)Br LS10232 [0,1,0,0,0,0|2,1,0]=4 228 B10R1.30 COc1cc(ccc1Cl)I LS10238 [0,1,0,0,0,0|2,1,0]=4 229 B10R1.30 COc1cc(ccc1F)F LS11368 [0,1,0,0,0,0|2,1,0]=4 230 B10R1.30 COc1cc(ccc1F)N LS10127 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.30 COc1cc(ccc1F)O LS10037 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.30 COc1cc(ccc1I)Cl LS10237 [0,1,0,0,0,0|2,0,0]=3 233 B10R1.30 COc1cc(ccc1N)Br LS10476 [0,1,0,0,0,0|2,1,0]=4 234 B10R1.30 COc1cc(ccc1N)I LS10552 [0,1,0,0,0,0|2,1,0]=4 235 B10R1.30 Cc1ccc(c(c1)OC)Br LS10017 [0,1,0,0,0,0|3,0,0]=4 236 B10R1.30 c1c(cnc(c1CO)N)Br LS20257 [0,1,0,0,0,0|1,1,1]=4 237 B10R1.30 c1cc(c(cc1Cl)C=O)N LS10227 [0,1,0,0,0,0|2,0,1]=4 238 B10R1.30 c1cc(c(cc1Cl)C=O)O LS11289 [0,1,0,0,0,0|1,0,2]=4 239 B10R1.30 c1cc(c(cc1Cl)NN)F LS10281 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.30 c1cc(c(cc1F)CO)Br LS10490 [0,1,0,0,0,0|2,1,0]=4 241 B10R1.118 Cc1cc(c(cc1Br)C)Cl LS10616 [0,1,0,0,0,0|3,0,0]=4 242 B10R1.118 Cc1cc(c(cc1Cl)F)N LS10381 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.118 Cc1cc(c(cc1O)N)Cl LS11398 [0,1,0,0,0,0|2,0,1]=4 244 B10R1.118 c1c(c(cc(c1N)O)O)N LS40770 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.119 Cc1ccc(c(c1O)Cl)N LS10462 [0,1,0,0,0,0|3,0,0]=4 246 B10R1.119 c1cc(c(c(c1N)F)Cl)Cl LS10025 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.176 c1cc(c(cc1C#N)O)O LS11705 [0,1,0,0,0,0|2,0,1]=4 248 B10R1.176 c1cc(c(cc1C=O)O)Br LS10136 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.176 c1cc(c(cc1C=O)O)O LS10200 [0,1,0,0,0,0|2,0,1]=4 250 B8R1.50 c1(c(=O)ssc1Cl)Cl LS40234 [0,0,0,0,1,0|3,0,0]=4 251 B7R1.3 c1c(cncn1)Cl LS20622 [2,0,0,0,0,0|1,0,1]=4 252 B7R1.3 c1cc(cnc1)Br LS20426 [2,0,0,0,0,0|0,1,1]=4 253 B7R1.3 c1cc(cnc1)F LS20779 [2,0,0,0,0,0|0,1,1]=4 254 B7R1.3 c1cc[nH]c(=O)c1 LS41474 [2,0,0,0,0,0|0,0,0]=2 255 B7R1.3 c1ccnc(c1)Br LS20874 [2,0,0,0,0,0|1,0,1]=4 256 B7R1.3 c1ccnc(c1)F LS20778 [2,0,0,0,0,0|1,0,1]=4 257 B7R1.3 c1ccnc(c1)N LS20582 [2,0,0,0,0,0|1,0,1]=4 258 B7R1.3 c1cnc(cn1)Cl LS20940 [2,0,0,0,0,0|1,0,1]=4 259 B7R1.3 c1cnccc1O LS21099 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.1 C=Cc1ccc(cc1)Cl LS11649 [1,1,0,0,0,0|2,0,0]=4 261 B9R1.1 c1cc(ccc1C=O)Cl LS10198 [1,1,0,0,0,0|1,0,0]=3 262 B9R1.1 c1cc(ccc1CCl)Cl LS11418 [1,1,0,0,0,0|2,0,0]=4 263 B9R1.1 c1cc(ncc1Br)C=O LS20518 [1,1,0,0,0,0|0,1,1]=4 264 B9R1.1 c1cc(ncc1C=O)Cl LS20242 [1,1,0,0,0,0|2,0,0]=4 265 B9R1.1 c1cc(ncc1Cl)C#N LS20081 [1,1,0,0,0,0|1,0,1]=4 266 B9R1.1 c1cc(ncc1Cl)C=O LS20775 [1,1,0,0,0,0|0,0,1]=3 267 B9R1.2 C=Cc1cccc(c1)Cl LS11652 [1,1,0,0,0,0|2,0,0]=4 268 B9R1.2 CNc1cccc(c1)Cl LS10187 [1,1,0,0,0,0|2,0,0]=4 269 B9R1.2 COc1cc(ccn1)Cl LS20320 [1,1,0,0,0,0|2,0,0]=4 270 B9R1.2 COc1cc(nnc1)Cl LS21025 [1,1,0,0,0,0|1,0,1]=4 271 B9R1.2 COc1cccc(n1)Cl LS20709 [1,1,0,0,0,0|2,0,0]=4 272 B9R1.2 Cc1cccc(c1)CCl LS11215 [1,1,0,0,0,0|2,0,0]=4 273 B9R1.2 c1cc(cc(c1)F)CO LS11387 [1,1,0,0,0,0|1,1,0]=4 274 B9R1.2 c1cc(cc(c1)O)C=O LS10593 [1,1,0,0,0,0|2,0,0]=4 275 B9R1.3 Cc1c(cccc1Cl)N LS11413 [1,1,0,0,0,0|2,0,0]=4 276 B9R1.3 Cc1c(cccc1F)O LS11582 [1,1,0,0,0,0|1,1,0]=4 277 B9R1.3 Cc1c(cccc1O)N LS11805 [1,1,0,0,0,0|2,0,0]=4 278 B9R1.3 Cc1c(cccc1O)O LS10121 [1,1,0,0,0,0|2,0,0]=4 279 B9R1.3 Cc1c(cncc1Cl)Cl LS20002 [1,1,0,0,0,0|1,0,1]=4 280 B9R1.3 Cc1cccc(c1F)O LS10317 [1,1,0,0,0,0|2,0,0]=4 281 B9R1.3 Cc1cccc(c1N)Cl LS10715 [1,1,0,0,0,0|2,0,0]=4 282 B9R1.3 Cc1cccc(c1O)Cl LS10669 [1,1,0,0,0,0|2,0,0]=4 283 B9R1.3 c1c(c(c(cn1)Cl)Cl)Cl LS20230 [1,1,0,0,0,0|1,0,1]=4 284 B9R1.3 c1c(c(c(cn1)Cl)N)Cl LS20507 [1,1,0,0,0,0|1,0,1]=4 285 B9R1.3 c1cc(c(c(c1)Br)Cl)Cl LS11372 [1,1,0,0,0,0|2,0,0]=4 286 B9R1.3 c1cc(c(c(c1)Br)Cl)O LS10087 [1,1,0,0,0,0|1,1,0]=4 287 B9R1.3 c1cc(c(c(c1)Cl)Br)Cl LS11199 [1,1,0,0,0,0|2,0,0]=4 288 B9R1.3 c1cc(c(c(c1)Cl)Cl)O LS11389 [1,1,0,0,0,0|1,0,0]=3 289 B9R1.3 c1cc(c(c(c1)Cl)F)F LS10287 [1,1,0,0,0,0|2,0,0]=4 290 B9R1.3 c1cc(c(c(c1)Cl)F)O LS10395 [1,1,0,0,0,0|1,0,0]=3 291 B9R1.3 c1cc(c(c(c1)Cl)I)N LS10555 [1,1,0,0,0,0|2,0,0]=4 292 B9R1.3 c1cc(c(c(c1)Cl)O)Cl LS10077 [1,1,0,0,0,0|2,0,0]=4 293 B9R1.3 c1cc(c(c(c1)Cl)O)F LS10396 [1,1,0,0,0,0|2,0,0]=4 294 B9R1.3 c1cc(c(c(c1)F)Cl)O LS10193 [1,1,0,0,0,0|1,1,0]=4 295 B9R1.3 c1cc(c(c(c1)F)O)O LS10021 [1,1,0,0,0,0|1,1,0]=4 296 B9R1.3 c1cc(c(c(c1)I)Cl)Cl LS11545 [1,1,0,0,0,0|2,0,0]=4 297 B9R1.3 c1cc(c(c(c1)I)N)Cl LS00034 [1,1,0,0,0,0|2,0,0]=4 298 B9R1.3 c1cc(c(c(c1)I)O)O LS10698 [1,1,0,0,0,0|1,1,0]=4 299 B9R1.3 c1cc(c(c(c1)O)F)O LS10311 [1,1,0,0,0,0|2,0,0]=4 300 B9R1.3 c1cc(c(c(c1)O)N)O LS11761 [1,1,0,0,0,0|2,0,0]=4 301 B9R1.3 c1cc(c(c(c1)O)N)O LS11782 [1,1,0,0,0,0|2,0,0]=4 302 B9R1.34 Cc1cc(cc(c1)Br)O LS10313 [1,1,0,0,0,0|1,1,0]=4 303 B9R1.34 c1c(cc(cc1Cl)Br)Cl LS10341 [1,1,0,0,0,0|2,0,0]=4 304 B9R1.34 c1c(cc(cc1Cl)Cl)O LS10337 [1,1,0,0,0,0|1,0,0]=3 305 B9R1.34 c1c(cc(cc1F)Cl)N LS00042 [1,1,0,0,0,0|2,0,0]=4 306 B9R1.34 c1c(cc(cc1F)F)O LS10458 [1,1,0,0,0,0|1,1,0]=4 307 B9R1.15 COc1cccnc1Br LS20368 [1,1,0,0,0,0|1,0,1]=4 308 B9R1.15 Cc1ccccc1C=O LS11852 [1,1,0,0,0,0|2,0,0]=4 309 B9R1.15 Cc1ccccc1CO LS11274 [1,1,0,0,0,0|2,0,0]=4 310 B9R1.15 c1cc(c(nc1)C=O)O LS20166 [1,1,0,0,0,0|0,0,1]=3 311 B9R1.15 c1cc(c(nc1)CO)O LS20165 [1,1,0,0,0,0|0,0,2]=4 312 B9R1.15 c1cc(c(nc1)Cl)CO LS20227 [1,1,0,0,0,0|1,0,1]=4 313 B9R1.15 c1cc(c(nc1)N)CO LS41435 [1,1,0,0,0,0|1,0,1]=4 314 B9R1.15 c1cc(c(nc1)O)C=O LS21175 [1,1,0,0,0,0|2,0,0]=4 315 B9R1.15 c1ccc(c(c1)C#N)O LS10639 [1,1,0,0,0,0|2,0,0]=4 316 B9R1.15 c1ccc(c(c1)C=O)N LS10114 [1,1,0,0,0,0|2,0,0]=4 317 B9R1.15 c1ccc(c(c1)CO)F LS11270 [1,1,0,0,0,0|2,0,0]=4 318 B9R1.15 c1ccc(c(c1)CO)I LS11276 [1,1,0,0,0,0|2,0,0]=4 319 B9R1.15 c1ccc(c(c1)CO)N LS10594 [1,1,0,0,0,0|2,0,0]=4 320 B9R1.37 C1(=C(C(=O)NC1=O)Br)Br LS40584 [0,1,0,0,1,0|2,0,0]=4 321 B11R1.464 c1c(cc(c(c1O)C=O)F)F LS10076 [0,2,0,0,0,0|1,1,0]=4 322 B11R1.37 COc1cc(ccc1C=O)F LS10599 [0,2,0,0,0,0|1,1,0]=4 323 B11R1.166 CC(=O)c1ccc(cc1F)Cl LS10306 [0,2,0,0,0,0|2,0,0]=4 324 B11R1.166 CC(=O)c1ccc(cc1O)F LS10126 [0,2,0,0,0,0|1,1,0]=4 325 B11R1.166 c1cc(c(cc1Cl)Cl)C(=O)O LS10673 [0,2,0,0,0,0|2,0,0]=4 326 B11R1.166 c1cc(c(cc1Cl)F)[N+](=O)[O-] LS00111 [0,2,0,0,0,0|2,0,0]=4 327 B11R1.166 c1cc(c(cc1Cl)N)C(=O)N LS10587 [0,2,0,0,0,0|2,0,0]=4 328 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O LS11433 [0,2,0,0,0,0|2,0,0]=4 329 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O LS10716 [0,2,0,0,0,0|1,0,0]=3 330 B11R1.166 c1cc(c(cc1F)O)C(=O)O LS11396 [0,2,0,0,0,0|1,1,0]=4 331 B11R1.166 c1cc(c(cc1O)O)C(=O)N LS10714 [0,2,0,0,0,0|2,0,0]=4 332 B11R1.166 c1cc(nc(c1[N+](=O)[O-])O)Cl LS20717 [0,2,0,0,0,0|2,0,0]=4 333 B11R1.277 c1c(c(cc(c1F)Cl)Cl)C=O LS10389 [0,2,0,0,0,0|2,0,0]=4 334 B11R1.277 c1c(c(cc(c1F)F)O)C=O LS10186 [0,2,0,0,0,0|1,1,0]=4 335 B11R1.279 c1cc(c(cc1C#N)O)C=O LS10079 [0,2,0,0,0,0|2,0,0]=4 336 B11R1.167 B(c1cc(ccc1C)Cl)(O)O LS11051 [0,2,0,0,0,0|2,0,0]=4 337 B11R1.167 B(c1cc(ccc1Cl)Cl)(O)O LS10934 [0,2,0,0,0,0|2,0,0]=4 338 B11R1.167 B(c1cc(ccc1F)Cl)(O)O LS11048 [0,2,0,0,0,0|2,0,0]=4 339 B11R1.167 B(c1cc(ccc1O)Cl)(O)O LS11049 [0,2,0,0,0,0|1,0,1]=4 340 B11R1.167 c1c(cnc(c1C(=O)O)Cl)Cl LS20422 [0,2,0,0,0,0|1,0,1]=4 341 B11R1.167 c1cc(c(cc1Cl)C(=O)O)Cl LS11832 [0,2,0,0,0,0|2,0,0]=4 342 B11R1.167 c1cc(c(cc1Cl)C(=O)O)N LS10348 [0,2,0,0,0,0|2,0,0]=4 343 B11R1.167 c1cc(c(cc1Cl)C(=O)O)O LS11420 [0,2,0,0,0,0|1,0,1]=4 344 B11R1.21 Cc1cc(c[nH]c1=O)[N+](=O)[O-] LS20732 [0,2,0,0,0,0|2,0,0]=4 345 B7R1.2 Cc1ccc(s1)Cl LS20653 [1,0,0,0,1,0|2,0,0]=4